2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol

C14H21NO2 — CID 107713118

IUPAC2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol
SMILESOCCc1ccccc1OCCN1CCCC1
InChIInChI=1S/C14H21NO2/c16-11-7-13-5-1-2-6-14(13)17-12-10-15-8-3-4-9-15/h1-2,5-6,16H,3-4,7-12H2
InChIKeyZJDMLZDYWVVJPR-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.70
Rot. Bonds6

About 2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol

2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol (PubChem CID 107713118) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol.

Molecular Properties

Compound Name2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol
PubChem CID107713118
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol
SMILESOCCc1ccccc1OCCN1CCCC1
InChIInChI=1S/C14H21NO2/c16-11-7-13-5-1-2-6-14(13)17-12-10-15-8-3-4-9-15/h1-2,5-6,16H,3-4,7-12H2
InChIKeyZJDMLZDYWVVJPR-UHFFFAOYSA-N
XLogP1.70
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-morpholin-4-ylethoxy)phenyl]ethanol
CID 107713272
1-[2-(2-propylphenoxy)ethyl]pyrrolidine
CID 173254301
1-[2-(2-butylphenoxy)ethyl]piperidine
CID 5129730
N,N-dimethyl-3-[2-(2-pyrrolidin-1-ylethoxy)phenyl]propan-1-amine
CID 170866493
1-methyl-4-[3-[2-(2-pyrrolidin-1-ylethoxy)phenyl]propyl]piperazine
CID 170863761
1-[2-(2-octylphenoxy)ethyl]piperidine chloride
CID 21228798
1-[2-[2-(2-hydroxyethyl)phenoxy]ethyl]pyridin-2-one
CID 107713241
2-[2-(3-pyrrolidin-1-ylpropoxy)phenyl]acetic acid
CID 11108172
2-[2-(azocan-1-yl)ethoxy]aniline
CID 43174279
1-[2-(2-ethoxyphenyl)ethyl]piperidine
CID 21117435
1-[3-(2-ethylphenoxy)propyl]pyrrolidine
CID 2262767
1-[2-(2-methoxyphenoxy)ethyl]piperidine
CID 867242

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol?
The IUPAC name of 2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol (CID 107713118) is 2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol.
What is the SMILES notation for 2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol?
The canonical SMILES for 2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol is OCCc1ccccc1OCCN1CCCC1.
What is the InChIKey of 2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol?
The InChIKey is ZJDMLZDYWVVJPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c16-11-7-13-5-1-2-6-14(13)17-12-10-15-8-3-4-9-15/h1-2,5-6,16H,3-4,7-12H2.
What are the key properties of 2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol?
2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol has a molecular weight of 235.33 g/mol, XLogP of 1.70, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-pyrrolidin-1-ylethoxy)phenyl]ethanol is sourced from PubChem (CID 107713118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).